COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079462
Chemical Name: ethyl({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nnc(n1CC=C)CSc1nc2c(s1)cccc2

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Molecular Weight: 406.55
Empirical Formula: C17H18N4O2S3

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.196
Rotatable bonds: 10
H-donors: 0
H-acceptors: 2
PSA: 148
Number of rings: 3

     

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